ethyl 7-cyano-1,5-dimethyl-3-oxidanylidene-2-oxabicyclo[4.2.0]oct-4-ene-6-carboxylate

Systemtic Name: ethyl 7-cyano-1,5-dimethyl-3-oxidanylidene-2-oxabicyclo[4.2.0]oct-4-ene-6-carboxylate Openeye Name: ethyl 7-cyano-1,5-dimethyl-3-oxo-2-oxabicyclo[4.2.0]oct-4-ene-6-carboxylate CAS Name: 7-cyano-1,5-dimethyl-3-oxo-2-oxabicyclo[4.2.0]oct-4-ene-6-carboxylic acid ethyl ester IUPAC Name: ethyl 7-cyano-1,5-dimethyl-3-oxo-2-oxabicyclo[4.2.0]oct-4-ene-6-carboxylate Traditional Name: 7-cyano-3-keto-1,5-dimethyl-2-oxabicyclo[4.2.0]oct-4-ene-6-carboxylic acid ethyl ester Formula: C13H15NO4 MolecularWeight: 249.2625

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C12C(CC1(OC(=O)C=C2C)C)C#N

Isomeric SMILES

CCOC(=O)C12C(CC1(OC(=O)C=C2C)C)C#N

InChI

InChI=1S/C13H15NO4/c1-4-17-11(16)13-8(2)5-10(15)18-12(13,3)6-9(13)7-14/h5,9H,4,6H2,1-3H3